5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide

C16H18N2O2 — CID 106956236

IUPAC5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide
SMILESCc1ccc(C)c(COc2ccc(N)cc2C(N)=O)c1
InChIInChI=1S/C16H18N2O2/c1-10-3-4-11(2)12(7-10)9-20-15-6-5-13(17)8-14(15)16(18)19/h3-8H,9,17H2,1-2H3,(H2,18,19)
InChIKeyRNUUFBXCAUVFFR-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.56
Rot. Bonds4

About 5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide

5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide (PubChem CID 106956236) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide.

Molecular Properties

Compound Name5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide
PubChem CID106956236
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide
SMILESCc1ccc(C)c(COc2ccc(N)cc2C(N)=O)c1
InChIInChI=1S/C16H18N2O2/c1-10-3-4-11(2)12(7-10)9-20-15-6-5-13(17)8-14(15)16(18)19/h3-8H,9,17H2,1-2H3,(H2,18,19)
InChIKeyRNUUFBXCAUVFFR-UHFFFAOYSA-N
XLogP2.56
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-2-(2,5-dimethylphenoxy)benzamide
CID 61306658
4-bromo-3-[(2,5-dimethylphenyl)methoxy]aniline
CID 103009356
4-amino-2-[(2-chloro-4-methylphenyl)methoxy]benzamide
CID 106955508
5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide
CID 106956184
5-amino-2-[(2-carbamoylphenyl)methoxy]benzoic acid
CID 43379987
5-amino-2-[(2-bromo-5-fluorophenyl)methoxy]benzamide
CID 106956029
5-amino-2-butoxybenzamide
CID 61305277
5-amino-2-(2-chloro-4-methylphenoxy)benzamide
CID 62671488
1-[4-[(2,5-dimethylphenyl)methoxy]-3-methylphenyl]ethanone
CID 82092576
5-amino-2-(3-amino-3-oxopropoxy)benzamide
CID 106956094
5-amino-2-(2-methoxypropoxy)benzamide
CID 106956252
3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine
CID 2735321

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide?
The IUPAC name of 5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide (CID 106956236) is 5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide.
What is the SMILES notation for 5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide?
The canonical SMILES for 5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide is Cc1ccc(C)c(COc2ccc(N)cc2C(N)=O)c1.
What is the InChIKey of 5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide?
The InChIKey is RNUUFBXCAUVFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-10-3-4-11(2)12(7-10)9-20-15-6-5-13(17)8-14(15)16(18)19/h3-8H,9,17H2,1-2H3,(H2,18,19).
What are the key properties of 5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide?
5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide has a molecular weight of 270.33 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide is sourced from PubChem (CID 106956236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).